SCHEMBL8993240

SCHEMBL8993240

COc1cc(-c2cnn3c(O)ncnc23)ccc1Cc1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
FYN P06241 4/20 0.38
SMPD3 Q9NY59 1/20 0.37
GPR119 Q8TDV5 1/20 0.35
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
KMT2A Q03164 4/20 0.35
NPC1 O15118 3/20 0.35
MEN1 O00255 3/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 4/20 0.35
ACVR2A P27037 1/20 0.34
TGFBR2 P37173 1/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
HPGD P15428 2/20 0.34
ACVRL1 P37023 1/20 0.34
GAA P10253 1/20 0.34
RET P07949 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8993293 0.92 KMT2A (0.40) MAPTFYNKMT2ANPC1MEN1
SCHEMBL8992897 0.91 FYN (0.41) MAPTFYNGPR119PDCD1CD274
SCHEMBL8993183 0.89 FYN (0.40) MAPTFYNGPR119PDCD1CD274
SCHEMBL8992894 0.87 MAPT (0.40) MAPTFYNGPR119PDCD1CD274
SCHEMBL8993192 0.85 FYN (0.41) MAPTFYNPDCD1CD274KMT2A
SCHEMBL8992845 0.85 FYN (0.40) MAPTFYNKMT2AMEN1TGFBR2
SCHEMBL8992831 0.84 LTA4H (0.42) MAPTFYNGPR119KMT2ANPC1
SCHEMBL8992965 0.83 GPR119 (0.41) MAPTGPR119KMT2ANPC1MEN1
SCHEMBL9219353 0.81 MAPT (0.56) MAPTFYNKMT2ANPC1MEN1
SCHEMBL9220988 0.79 MAPT (0.45) MAPTFYNKMT2ANPC1MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5516777-A PROSTATE CANCER THERAPY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-05-14 US disclosed
US-5409928-A Prostate diseases, alopecia OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-04-25 US disclosed
EP-0594149-A2 Condensed pyrazole derivatives, method of manufacturing the same, and androgen inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-04-27 EP disclosed